2-(3,5-dimethyl-2-oxidanyl-phenyl)-2-[2-[[1-(3,5-dimethyl-2-oxidanyl-phenyl)-2-oxidanyl-2-oxidanylidene-ethyl]amino]ethylamino]ethanoic acid; technetium-99

Systemtic Name: 2-(3,5-dimethyl-2-oxidanyl-phenyl)-2-[2-[[1-(3,5-dimethyl-2-oxidanyl-phenyl)-2-oxidanyl-2-oxidanylidene-ethyl]amino]ethylamino]ethanoic acid; technetium-99 Openeye Name: 2-(2-hydroxy-3,5-dimethyl-phenyl)-2-[2-[[2-hydroxy-1-(2-hydroxy-3,5-dimethyl-phenyl)-2-oxo-ethyl]amino]ethylamino]acetic acid; technetium-99 CAS Name: 2-(2-hydroxy-3,5-dimethylphenyl)-2-[2-[[2-hydroxy-1-(2-hydroxy-3,5-dimethylphenyl)-2-oxoethyl]amino]ethylamino]acetic acid; technetium-99 IUPAC Name: 2-(2-hydroxy-3,5-dimethylphenyl)-2-[2-[[2-hydroxy-1-(2-hydroxy-3,5-dimethylphenyl)-2-oxoethyl]amino]ethylamino]acetic acid; technetium-99 Traditional Name: 2-(2-hydroxy-3,5-dimethyl-phenyl)-2-[2-[[2-hydroxy-1-(2-hydroxy-3,5-dimethyl-phenyl)-2-keto-ethyl]amino]ethylamino]acetic acid; technetium-99 Formula: C22H28N2O6Tc MolecularWeight: 515.373775

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C(C(=O)O)NCCNC(C2=CC(=CC(=C2O)C)C)C(=O)O)O)C.[Tc]

Isomeric SMILES

CC1=CC(=C(C(=C1)C(C(=O)O)NCCNC(C2=CC(=CC(=C2O)C)C)C(=O)O)O)C.[99Tc]

InChI

InChI=1S/C22H28N2O6.Tc/c1-11-7-13(3)19(25)15(9-11)17(21(27)28)23-5-6-24-18(22(29)30)16-10-12(2)8-14(4)20(16)26;/h7-10,17-18,23-26H,5-6H2,1-4H3,(H,27,28)(H,29,30);/i;1+1